5-bromanyl-N-[(1-naphthalen-1-ylsulfonylpiperidin-2-yl)methyl]pyrimidin-2-amine

Systemtic Name: 5-bromanyl-N-[(1-naphthalen-1-ylsulfonylpiperidin-2-yl)methyl]pyrimidin-2-amine Openeye Name: 5-bromo-N-[[1-(1-naphthylsulfonyl)-2-piperidyl]methyl]pyrimidin-2-amine CAS Name: 5-bromo-N-[[1-(1-naphthalenylsulfonyl)-2-piperidinyl]methyl]-2-pyrimidinamine IUPAC Name: 5-bromo-N-[(1-naphthalen-1-ylsulfonylpiperidin-2-yl)methyl]pyrimidin-2-amine Traditional Name: (5-bromopyrimidin-2-yl)-[[1-(1-naphthylsulfonyl)-2-piperidyl]methyl]amine Formula: C20H21BrN4O2S MolecularWeight: 461.37534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CNC2=NC=C(C=N2)Br)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(C(C1)CNC2=NC=C(C=N2)Br)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H21BrN4O2S/c21-16-12-22-20(23-13-16)24-14-17-8-3-4-11-25(17)28(26,27)19-10-5-7-15-6-1-2-9-18(15)19/h1-2,5-7,9-10,12-13,17H,3-4,8,11,14H2,(H,22,23,24)